Merge branch 'prerelease-3.2.1' into czarek

[unres.git] / examples / unres / REMD / Langevin / ff_1l2y / outputs / 1L2Y_REMD_GB015.stat

diff --git a/examples/unres/REMD/Langevin/ff_1l2y/outputs/1L2Y_REMD_GB015.stat b/examples/unres/REMD/Langevin/ff_1l2y/outputs/1L2Y_REMD_GB015.stat
new file mode 100644 (file)
index 0000000..18ecc6d
--- /dev/null
+++ b/examples/unres/REMD/Langevin/ff_1l2y/outputs/1L2Y_REMD_GB015.stat
@@ -0,0 +1,101 @@
+         0           0.00      41.798     112.326     154.124  12.87 0.000   NaN   NaN 4.849     379.213     400.000      15.552   15 
+     10000        2000.00      47.167      19.056      66.223  10.27 0.000   NaN   NaN 1.443     427.922     400.000      13.817   15 
+     20000        4000.00      52.932      14.188      67.120   8.70 0.071 0.000 0.136 1.432     480.224     400.000      10.715   15 
+     30000        6000.00      43.970       9.018      52.988   6.63 0.071 0.800 0.282 1.066     398.917     400.000       8.462   15 
+     40000        8000.00      41.308      13.710      55.018   5.40 0.071 0.000 0.136 0.802     374.771     400.000       9.490   15 
+     50000       10000.00      46.774      18.409      65.183   8.48 0.071 0.000 0.136 0.538     424.360     400.000      11.498   15 
+     60000       12000.00      46.520       5.638      52.158   9.60 0.143 0.000 0.136 0.297     422.050     400.000      12.306   15 
+     70000       14000.00      46.951       9.080      56.030   9.59 0.071 0.000 0.136 0.375     425.961     400.000      12.785   15 
+     80000       16000.00      39.967       4.613      44.580   5.75 0.000 1.000 0.136 0.362     362.605     400.000       9.319   15 
+     90000       18000.00      35.355       9.244      44.600   7.02 0.000 1.000 0.170 0.844     320.762     400.000       9.215   15 
+    100000       20000.00      41.916       7.958      49.874   8.42 0.000 1.000 0.182 0.497     380.288     400.000      11.554   15 
+    110000       22000.00      40.178      12.097      52.276   7.58 0.000 1.000 0.227 0.659     364.519     400.000      10.349   15 
+    120000       24000.00      41.243      15.230      56.472   7.34 0.071 0.500 0.136 0.312     374.174     400.000      11.555   15 
+    130000       26000.00      37.711      18.212      55.922   6.30 0.071 0.000 0.136 0.210     342.130     400.000      10.094   15 
+    140000       28000.00      40.379      11.812      52.191   8.85 0.071 0.667 0.197 0.250     366.336     400.000      10.437   15 
+    150000       30000.00      38.772      13.316      52.087   7.37 0.000 1.000 0.212 0.612     351.756     400.000       9.117   15 
+    160000       32000.00      45.593       8.125      53.718   6.89 0.071 0.800 0.245 0.965     413.642     400.000      10.582   15 
+    170000       34000.00      42.033       6.452      48.485   6.93 0.143 0.333 0.212 0.411     381.344     400.000      11.026   15 
+    180000       36000.00      55.594       1.882      57.476   6.16 0.071 0.750 0.330 0.478     504.379     400.000       8.144   15 
+    190000       38000.00      49.776      14.483      64.259   5.46 0.071 0.857 0.279 1.031     451.591     400.000       7.919   15 
+    200000       40000.00      43.674      -0.238      43.436   6.17 0.071 0.857 0.240 0.649     396.235     400.000       7.707   15 
+    210000       42000.00      36.593       4.887      41.479   8.08 0.143 0.600 0.173 1.093     331.989     390.000       9.819   15 
+    220000       44000.00      50.281      12.698      62.980   6.35 0.143 0.333 0.152 0.422     456.179     390.000       9.505   15 
+    230000       46000.00      36.283      15.026      51.309   7.50 0.000 1.000 0.182 0.606     329.177     390.000      10.669   15 
+    240000       48000.00      39.818       3.224      43.042   6.91 0.143 0.600 0.173 0.924     361.247     390.000       9.290   15 
+    250000       50000.00      42.666      19.002      61.669   6.86 0.000 1.000 0.182 0.522     387.092     390.000      10.079   15 
+    260000       52000.00      40.876       4.614      45.490   5.74 0.071 0.750 0.239 0.138     370.845     390.000       9.061   15 
+    270000       54000.00      43.457       7.851      51.309   6.70 0.071 0.875 0.341 0.658     394.268     390.000       7.202   15 
+    280000       56000.00      42.986       9.789      52.775   5.89 0.071 0.750 0.318 0.632     389.992     390.000       7.427   15 
+    290000       58000.00      40.141       8.732      48.873   6.21 0.000 1.000 0.409 0.574     364.179     390.000       8.811   15 
+    300000       60000.00      42.348       4.204      46.552   7.50 0.000 1.000 0.136 0.395     384.202     390.000       9.006   15 
+    310000       62000.00      32.512       6.342      38.854  10.11 0.000   NaN   NaN 0.292     294.967     380.000      13.156   15 
+    320000       64000.00      49.687      12.416      62.103   5.45 0.000 1.000 0.182 0.657     450.787     380.000      10.454   15 
+    330000       66000.00      38.794      16.218      55.012   8.65 0.071 0.000 0.136 0.268     351.959     380.000      11.855   15 
+    340000       68000.00      56.270      -1.583      54.687   3.96 0.143 0.500 0.216 0.955     510.510     380.000       7.986   15 
+    350000       70000.00      42.679       8.929      51.608   5.46 0.071 0.667 0.348 0.388     387.203     380.000       7.893   15 
+    360000       72000.00      40.046      11.333      51.379   6.92 0.071 0.800 0.236 0.359     363.321     380.000       8.240   15 
+    370000       74000.00      44.169      10.265      54.434   9.10 0.000 1.000 0.182 0.336     400.728     380.000      12.346   15 
+    380000       76000.00      40.596      12.964      53.560   7.06 0.000 1.000 0.205 0.586     368.305     380.000      11.081   15 
+    390000       78000.00      47.298       7.034      54.332   5.84 0.000 1.000 0.318 0.390     429.113     380.000       8.346   15 
+    400000       80000.00      38.886      13.332      52.218   5.60 0.143 0.500 0.159 0.372     352.797     380.000       8.427   15 
+    410000       82000.00      43.535       1.239      44.774   5.60 0.000 1.000 0.403 0.340     394.968     370.000       8.071   15 
+    420000       84000.00      36.000       2.362      38.363   5.39 0.071 0.750 0.295 0.322     326.611     370.000       8.395   15 
+    430000       86000.00      45.568       5.863      51.431   5.07 0.143 0.500 0.398 0.335     413.419     370.000       8.193   15 
+    440000       88000.00      49.657      12.092      61.749   7.20 0.071 0.500 0.136 1.009     450.512     370.000       8.426   15 
+    450000       90000.00      44.614       7.518      52.132   6.93 0.214 0.727 0.289 0.452     404.758     370.000       7.912   15 
+    460000       92000.00      39.874      16.888      56.762   6.52 0.071 0.750 0.375 0.530     361.755     370.000       8.767   15 
+    470000       94000.00      50.256      -5.876      44.381   5.06 0.143 0.800 0.359 0.765     455.953     370.000       6.688   15 
+    480000       96000.00      39.994      -3.114      36.881   4.08 0.143 0.800 0.491 0.442     362.848     370.000       7.431   15 
+    490000       98000.00      35.458      -0.545      34.913   3.28 0.143 0.667 0.273 0.394     321.691     370.000       7.540   15 
+    500000      100000.00      36.665       2.071      38.735   3.72 0.000 1.000 0.312 0.541     332.640     370.000       7.517   15 
+    510000      102000.00      34.131       0.811      34.942   4.48 0.143 0.750 0.398 0.520     309.653     360.000       7.181   15 
+    520000      104000.00      36.755      -5.764      30.992   5.17 0.143 0.833 0.379 0.706     333.464     360.000       6.994   15 
+    530000      106000.00      53.797       0.459      54.257   5.51 0.000 1.000 0.303 1.239     488.075     360.000       8.093   15 
+    540000      108000.00      36.505       2.862      39.367   4.87 0.143 0.667 0.318 0.380     331.190     360.000       7.581   15 
+    550000      110000.00      37.220      -0.214      37.007   6.18 0.143 0.778 0.419 0.591     337.684     360.000       8.012   15 
+    560000      112000.00      45.403      -3.279      42.124   7.02 0.071 0.750 0.159 0.499     411.920     360.000      10.788   15 
+    570000      114000.00      34.611      -7.162      27.449   6.06 0.143 0.667 0.205 1.130     314.005     360.000       9.405   15 
+    580000      116000.00      35.274      -7.531      27.743   7.51 0.143 0.667 0.205 0.841     320.024     360.000       9.862   15 
+    590000      118000.00      36.968      -0.977      35.991   5.96 0.071 0.909 0.298 0.860     335.393     360.000       7.492   15 
+    600000      120000.00      36.860       0.003      36.863   5.36 0.071 0.800 0.355 0.699     334.409     360.000       8.242   15 
+    610000      122000.00      33.460      -0.100      33.361   5.60 0.143 0.714 0.201 0.413     303.570     350.000       7.542   15 
+    620000      124000.00      41.088      -2.997      38.091   3.29 0.214 0.667 0.399 0.384     372.769     350.000       7.010   15 
+    630000      126000.00      36.972       4.933      41.905   4.14 0.071 0.917 0.375 0.354     335.432     350.000       7.469   15 
+    640000      128000.00      43.252      -2.188      41.064   4.69 0.214 0.625 0.176 0.241     392.404     350.000       8.761   15 
+    650000      130000.00      44.666     -10.966      33.700   4.42 0.143 0.800 0.286 0.976     405.231     350.000       6.660   15 
+    660000      132000.00      48.836      -7.437      41.400   4.91 0.357 0.583 0.432 0.464     443.066     350.000       6.747   15 
+    670000      134000.00      36.128     -10.893      25.235   4.55 0.143 0.800 0.232 0.471     327.772     350.000       7.618   15 
+    680000      136000.00      38.181      -9.460      28.721   4.23 0.214 0.700 0.359 1.160     346.395     350.000       6.963   15 
+    690000      138000.00      40.924      -8.757      32.166   4.48 0.143 0.778 0.429 0.620     371.280     350.000       7.416   15 
+    700000      140000.00      42.812      14.031      56.844   4.48 0.071 0.667 0.212 0.890     388.416     350.000       8.160   15 
+    710000      142000.00      46.355       4.712      51.067   4.46 0.214 0.625 0.420 0.621     420.558     400.000       7.761   15 
+    720000      144000.00      38.329       1.406      39.735   5.67 0.000 1.000 0.336 0.147     347.741     400.000       8.357   15 
+    730000      146000.00      44.995       6.179      51.174   5.64 0.000 1.000 0.197 0.641     408.218     400.000       9.344   15 
+    740000      148000.00      50.482      17.769      68.251   5.44 0.000 1.000 0.379 0.790     457.998     400.000       8.152   15 
+    750000      150000.00      39.392       6.684      46.076   5.85 0.000 1.000 0.264 0.902     357.380     400.000       9.669   15 
+    760000      152000.00      47.167      14.616      61.783   5.53 0.000   NaN   NaN 0.527     427.927     400.000       9.611   15 
+    770000      154000.00      39.424      13.553      52.977   5.66 0.000 1.000 0.182 0.262     357.674     400.000       9.849   15 
+    780000      156000.00      43.451      -3.862      39.589   6.91 0.143 0.714 0.273 0.229     394.212     400.000       7.862   15 
+    790000      158000.00      44.827       5.530      50.357   4.94 0.000 1.000 0.386 0.532     406.694     400.000       7.314   15 
+    800000      160000.00      39.082       9.569      48.651   4.73 0.143 0.714 0.442 1.020     354.568     400.000       7.325   15 
+    810000      162000.00      41.722      -2.860      38.862   5.80 0.143 0.818 0.227 0.625     378.522     390.000       8.210   15 
+    820000      164000.00      42.186       0.611      42.797   4.28 0.000 1.000 0.278 0.962     382.734     390.000       7.598   15 
+    830000      166000.00      40.799      -3.468      37.331   4.87 0.143 0.818 0.252 0.610     370.146     390.000       7.475   15 
+    840000      168000.00      49.076       4.757      53.833   5.27 0.000 1.000 0.318 0.701     445.247     390.000       7.538   15 
+    850000      170000.00      39.648       9.288      48.935   4.19 0.143 0.714 0.201 0.310     359.705     390.000       8.169   15 
+    860000      172000.00      46.551       8.694      55.245   6.78 0.214 0.500 0.250 0.591     422.334     390.000       8.319   15 
+    870000      174000.00      37.460      16.138      53.598   6.03 0.071 0.000 0.182 0.488     339.854     390.000      11.005   15 
+    880000      176000.00      41.387       7.164      48.551   5.59 0.214 0.571 0.162 0.693     375.485     390.000       9.705   15 
+    890000      178000.00      40.249      -0.276      39.973   7.06 0.071 0.750 0.205 0.504     365.155     390.000       9.164   15 
+    900000      180000.00      45.533      13.152      58.685   6.46 0.071 0.500 0.159 0.446     413.102     390.000      10.519   15 
+    910000      182000.00      40.604      10.317      50.921   9.20 0.000 1.000 0.227 0.574     368.377     380.000      11.727   15 
+    920000      184000.00      35.305      14.641      49.946   5.85 0.143 0.000 0.159 0.899     320.306     380.000      10.455   15 
+    930000      186000.00      41.746       5.240      46.986   5.29 0.143 0.750 0.477 0.744     378.746     380.000       8.652   15 
+    940000      188000.00      49.629       6.468      56.097   6.72 0.000 1.000 0.545 0.380     450.257     380.000       8.850   15 
+    950000      190000.00      36.160       7.654      43.814   6.47 0.071 0.800 0.291 0.399     328.059     380.000       7.833   15 
+    960000      192000.00      49.449      11.639      61.088   6.47 0.143 0.714 0.422 1.057     448.631     380.000       7.220   15 
+    970000      194000.00      39.888      12.409      52.297   5.26 0.000 1.000 0.182 0.531     361.882     380.000       8.698   15 
+    980000      196000.00      42.992       4.674      47.666   3.82 0.143 0.714 0.234 0.295     390.043     380.000       7.494   15 
+    990000      198000.00      40.329       9.248      49.577   5.89 0.071 0.750 0.193 0.431     365.884     380.000      10.000   15 
+   1000000      200000.00      42.584      19.648      62.231   9.16 0.143 0.000 0.136 0.949     386.340     380.000      11.436   15